Chemical Properties of 2-(2-Hydroxy-4-methyl-phenyl)-pentan-3-one

2-(2-Hydroxy-4-methyl-phenyl)-pentan-3-one

InChI
InChI=1S/C12H16O2/c1-4-11(13)9(3)10-6-5-8(2)7-12(10)14/h5-7,9,14H,4H2,1-3H3
InChI Key
XKKGHYTULRMGQQ-UHFFFAOYSA-N
Formula
C12H16O2
SMILES
CCC(=O)C(C)c1ccc(C)cc1O
Molecular Weight1
192.25
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Physical Properties

Property Value Unit Source
ΔfH°gas -362.29 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 24.35 kJ/mol Joback Calculated Property
ΔvapH° 82.49 kJ/mol Relay (1.0) Calculated Property
log10WS -1.95 Relay (1.0) Calculated Property
logPoct/wat 2.783 Crippen Calculated Property
McVol 163.620 ml/mol McGowan Calculated Property
I [2620.00; 2620.00]   Show Hide
I 2620.00 NIST
I 2620.00 NIST
Tboil 553.79 K Relay (1.0) Calculated Property
Tc 775.56 K Relay (1.0) Calculated Property
Tfus 370.73 K Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [222.84; 528.83] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.08690e+01
Coefficient B1.13796e+00
Coefficient C-8.34020e-04
Coefficient D2.55760e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 222.84 J/mol×K 273.00 Calculated Property
Cp,gas 278.66 J/mol×K 353.78 Calculated Property
Cp,gas 327.13 J/mol×K 434.56 Calculated Property
Cp,gas 369.07 J/mol×K 515.33 Calculated Property
Cp,gas 405.29 J/mol×K 596.11 Calculated Property
Cp,gas 436.59 J/mol×K 676.89 Calculated Property
Cp,gas 463.79 J/mol×K 757.67 Calculated Property
Cp,gas 487.69 J/mol×K 838.44 Calculated Property
Cp,gas 509.10 J/mol×K 919.22 Calculated Property
Cp,gas 528.83 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0010385; 0.0000384] Pa×s [410.59; 604.50] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.71462e+01
Coefficient B4.21931e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.410.59
Temperature range, max.604.50
η 0.0010385 Pa×s 410.59 Calculated Property
η 0.0006222 Pa×s 432.14 Calculated Property
η 0.0003913 Pa×s 453.68 Calculated Property
η 0.0002567 Pa×s 475.23 Calculated Property
η 0.0001747 Pa×s 496.77 Calculated Property
η 0.0001227 Pa×s 518.32 Calculated Property
η 0.0000887 Pa×s 539.86 Calculated Property
η 0.0000657 Pa×s 561.41 Calculated Property
η 0.0000498 Pa×s 582.95 Calculated Property
η 0.0000384 Pa×s 604.50 Calculated Property

Similar Compounds

3-(2-Hydroxy-4-methyl-phenyl)-butan-2-one. Curcuphenol. [4-(5-Hydroxy-2,4-dimethoxyphenyl)-3-methoxycarbonylmethyl-5-oxocyclohexyl]acetic acid, methyl ester. [4-(5-Hydroxy-2,4-dimethoxyphenyl)-3-methoxycarbonylmethyl-5-oxocyclohexyl-1)-acetic acid, methyl ester. Sesquichamaenol. 2,4-Bis(1-methylbutyl)phenol. Penbutolol hydroxy, acetylated. Exaprolol, HFB. Cinchonan-9-ol, 10,11-dihydro-6'-methoxy-, (8«alpha»,9R)-. Hydroquinidine. N-Desmethyl-cis-tramadol. 4'-O-Methylglabridin. O-sec-amylphenol. 4-Cyclohexylresorcinol. 6,7;7,10-Bisepoxy-6,7-seco-calamenene.

Find more compounds similar to 2-(2-Hydroxy-4-methyl-phenyl)-pentan-3-one.

Sources

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